1-methyl-N-[1-(4-methylphenoxy)propan-2-yl]piperidine-4-carboxamide

C17H26N2O2 — CID 132649936

IUPAC1-methyl-N-[1-(4-methylphenoxy)propan-2-yl]piperidine-4-carboxamide
SMILESCc1ccc(OCC(C)NC(=O)C2CCN(C)CC2)cc1
InChIInChI=1S/C17H26N2O2/c1-13-4-6-16(7-5-13)21-12-14(2)18-17(20)15-8-10-19(3)11-9-15/h4-7,14-15H,8-12H2,1-3H3,(H,18,20)
InChIKeyFJEKAFBNGOPTLW-UHFFFAOYSA-N
MW290.41 g/mol
LogP2.22
Rot. Bonds5

About 1-methyl-N-[1-(4-methylphenoxy)propan-2-yl]piperidine-4-carboxamide

1-methyl-N-[1-(4-methylphenoxy)propan-2-yl]piperidine-4-carboxamide (PubChem CID 132649936) has the molecular formula C17H26N2O2 and a molecular weight of 290.41 g/mol. Its IUPAC name is 1-methyl-N-[1-(4-methylphenoxy)propan-2-yl]piperidine-4-carboxamide.

Molecular Properties

Compound Name1-methyl-N-[1-(4-methylphenoxy)propan-2-yl]piperidine-4-carboxamide
PubChem CID132649936
Molecular FormulaC17H26N2O2
Molecular Weight290.41 g/mol
Exact Mass290.20
IUPAC Name1-methyl-N-[1-(4-methylphenoxy)propan-2-yl]piperidine-4-carboxamide
SMILESCc1ccc(OCC(C)NC(=O)C2CCN(C)CC2)cc1
InChIInChI=1S/C17H26N2O2/c1-13-4-6-16(7-5-13)21-12-14(2)18-17(20)15-8-10-19(3)11-9-15/h4-7,14-15H,8-12H2,1-3H3,(H,18,20)
InChIKeyFJEKAFBNGOPTLW-UHFFFAOYSA-N
XLogP2.22
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(3R)-1-methyl-N-[(2R)-1-(4-methylphenoxy)propan-2-yl]piperidine-3-carboxamide
CID 99970521
1-[(4-chlorophenyl)methyl]-N-[(2S)-1-(4-methylphenoxy)propan-2-yl]piperidine-4-carboxamide
CID 94013561
N-[(2R)-1-(4-methylphenoxy)propan-2-yl]-1-[(2-methylphenyl)methyl]piperidine-4-carboxamide
CID 94013550
1-(4-methoxyphenyl)sulfonyl-N-[1-(4-methylphenoxy)propan-2-yl]piperidine-4-carboxamide
CID 133167697
1-N-[1-(4-methylphenoxy)propan-2-yl]piperidine-1,4-dicarboxamide
CID 51096030
N-[2-[[(2R)-1-(4-methylphenoxy)propan-2-yl]amino]-2-oxoethyl]cyclopropanecarboxamide
CID 95157805
1-methyl-N-[1-(4-methylphenoxy)propan-2-yl]piperidin-4-amine
CID 61168104
(3R)-N-[(2R)-1-(4-methylphenoxy)propan-2-yl]-1-(4-methylphenyl)sulfonylpiperidine-3-carboxamide
CID 100666449
N-[(2S)-1-(4-methoxyphenoxy)propan-2-yl]-1-(4-methoxyphenyl)sulfonylpiperidine-4-carboxamide
CID 100654629
N-[1-(4-methoxyphenoxy)propan-2-yl]-1-(4-methoxyphenyl)sulfonylpiperidine-4-carboxamide
CID 133167682
(3R)-1-(benzenesulfonyl)-N-[(2R)-1-(4-methylphenoxy)propan-2-yl]piperidine-3-carboxamide
CID 99254445
2-amino-N-[1-(4-methylphenoxy)propan-2-yl]cyclopentane-1-carboxamide
CID 64822656

Frequently Asked Questions

What is the IUPAC name of 1-methyl-N-[1-(4-methylphenoxy)propan-2-yl]piperidine-4-carboxamide?
The IUPAC name of 1-methyl-N-[1-(4-methylphenoxy)propan-2-yl]piperidine-4-carboxamide (CID 132649936) is 1-methyl-N-[1-(4-methylphenoxy)propan-2-yl]piperidine-4-carboxamide.
What is the SMILES notation for 1-methyl-N-[1-(4-methylphenoxy)propan-2-yl]piperidine-4-carboxamide?
The canonical SMILES for 1-methyl-N-[1-(4-methylphenoxy)propan-2-yl]piperidine-4-carboxamide is Cc1ccc(OCC(C)NC(=O)C2CCN(C)CC2)cc1.
What is the InChIKey of 1-methyl-N-[1-(4-methylphenoxy)propan-2-yl]piperidine-4-carboxamide?
The InChIKey is FJEKAFBNGOPTLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O2/c1-13-4-6-16(7-5-13)21-12-14(2)18-17(20)15-8-10-19(3)11-9-15/h4-7,14-15H,8-12H2,1-3H3,(H,18,20).
What are the key properties of 1-methyl-N-[1-(4-methylphenoxy)propan-2-yl]piperidine-4-carboxamide?
1-methyl-N-[1-(4-methylphenoxy)propan-2-yl]piperidine-4-carboxamide has a molecular weight of 290.41 g/mol, XLogP of 2.22, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-[1-(4-methylphenoxy)propan-2-yl]piperidine-4-carboxamide is sourced from PubChem (CID 132649936), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).